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Compound Detail

CHEMBL5195648

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Basic Information

ChEMBL ID CHEMBL5195648
Phase Preclinical
Structure Type MOL
InChI Key CDFUVXUAFYQGMT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

109.2
MW (Da)
1.12
ALogP
2
HBA
0
HBD
12.9
PSA (Ų)
0.45
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C5H3NS
MW 109.15
Aromatic Rings 1
Heavy Atoms 7
NP-Likeness -1.50

Literature References

PubMed DOI Target Context # Activities
35984756 10.1021/acs.jmedchem.2c00909 HCT-116 1
35984756 10.1021/acs.jmedchem.2c00909 NCI-H522 1

Data from ChEMBL 36 via Core Engine